# generated using pymatgen
data_Nd5SiS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.13929410
_cell_length_b   7.13929417
_cell_length_c   7.13929441
_cell_angle_alpha   99.54442623
_cell_angle_beta   99.54442662
_cell_angle_gamma   131.94179136
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd5SiS4
_chemical_formula_sum   'Nd5 Si1 S4'
_cell_volume   247.21115688
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Nd  Nd0  1  0.40192657  0.79811178  0.20003835  1.0
  Nd  Nd1  1  0.00000000  0.00000000  0.00000000  1.0
  Nd  Nd2  1  0.59807343  0.20188822  0.79996165  1.0
  Nd  Nd3  1  0.20188822  0.40192657  0.60381380  1.0
  Nd  Nd4  1  0.79811178  0.59807343  0.39618620  1.0
  Si  Si5  1  0.50000000  0.50000000  0.00000000  1.0
  S  S6  1  0.10124068  0.69930852  0.80054820  1.0
  S  S7  1  0.69930852  0.89875932  0.59806784  1.0
  S  S8  1  0.30069148  0.10124068  0.40193216  1.0
  S  S9  1  0.89875932  0.30069148  0.19945180  1.0